3-{[3-(4-chlorophenyl)-5-oxo-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-4(5H)-yl]methyl}-4-methoxybenzaldehyde
Chemical Structure Depiction of
3-{[3-(4-chlorophenyl)-5-oxo-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-4(5H)-yl]methyl}-4-methoxybenzaldehyde
3-{[3-(4-chlorophenyl)-5-oxo-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-4(5H)-yl]methyl}-4-methoxybenzaldehyde
Compound characteristics
| Compound ID: | C746-0030 |
| Compound Name: | 3-{[3-(4-chlorophenyl)-5-oxo-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-4(5H)-yl]methyl}-4-methoxybenzaldehyde |
| Molecular Weight: | 493 |
| Molecular Formula: | C25 H17 Cl N2 O3 S2 |
| Smiles: | COc1ccc(C=O)cc1CN1C2=C(c3ccc(cc3)[Cl])SC(N2c2ccccc2C1=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.6328 |
| logD: | 5.6328 |
| logSw: | -5.9412 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 39.578 |
| InChI Key: | MKSUBXSLRIESBC-UHFFFAOYSA-N |